About 2-(aminomethyl)-3-trimethoxysilylpropan-1-ol
2-(aminomethyl)-3-trimethoxysilylpropan-1-ol (PubChem CID 154196411) has the molecular formula C7H19NO4Si
and a molecular weight of 209.32 g/mol. Its IUPAC name is 2-(aminomethyl)-3-trimethoxysilylpropan-1-ol.
Molecular Properties
| Compound Name | 2-(aminomethyl)-3-trimethoxysilylpropan-1-ol |
| PubChem CID | 154196411 |
| Molecular Formula | C7H19NO4Si |
| Molecular Weight | 209.32 g/mol |
| Exact Mass | 209.11 |
| IUPAC Name | 2-(aminomethyl)-3-trimethoxysilylpropan-1-ol |
| SMILES | CO[Si](CC(CN)CO)(OC)OC |
| InChI | InChI=1S/C7H19NO4Si/c1-10-13(11-2,12-3)6-7(4-8)5-9/h7,9H,4-6,8H2,1-3H3 |
| InChIKey | BMVJLODMRABQES-UHFFFAOYSA-N |
| XLogP | -0.57 |
| TPSA | 73.94 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 209.32 |
| LogP ≤ 5 | -0.57 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 5 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
|---|
Analyze 2-(aminomethyl)-3-trimethoxysilylpropan-1-ol with MolForge
Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.
Launch Full Analysis
Frequently Asked Questions
What is the IUPAC name of 2-(aminomethyl)-3-trimethoxysilylpropan-1-ol?
The IUPAC name of 2-(aminomethyl)-3-trimethoxysilylpropan-1-ol (CID 154196411) is 2-(aminomethyl)-3-trimethoxysilylpropan-1-ol.
What is the SMILES notation for 2-(aminomethyl)-3-trimethoxysilylpropan-1-ol?
The canonical SMILES for 2-(aminomethyl)-3-trimethoxysilylpropan-1-ol is CO[Si](CC(CN)CO)(OC)OC.
What is the InChIKey of 2-(aminomethyl)-3-trimethoxysilylpropan-1-ol?
The InChIKey is BMVJLODMRABQES-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H19NO4Si/c1-10-13(11-2,12-3)6-7(4-8)5-9/h7,9H,4-6,8H2,1-3H3.
What are the key properties of 2-(aminomethyl)-3-trimethoxysilylpropan-1-ol?
2-(aminomethyl)-3-trimethoxysilylpropan-1-ol has a molecular weight of 209.32 g/mol, XLogP of -0.57, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-3-trimethoxysilylpropan-1-ol is sourced from PubChem (CID 154196411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).